(2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine

C10H17F2NO — CID 129348729

IUPAC(2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine
SMILESFC(F)[C@H]1CCCN1C[C@H]1CCOC1
InChIInChI=1S/C10H17F2NO/c11-10(12)9-2-1-4-13(9)6-8-3-5-14-7-8/h8-10H,1-7H2/t8-,9-/m1/s1
InChIKeySPLMNBHQCAUQGL-RKDXNWHRSA-N
MW205.25 g/mol
LogP1.75
Rot. Bonds3

About (2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine

(2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine (PubChem CID 129348729) has the molecular formula C10H17F2NO and a molecular weight of 205.25 g/mol. Its IUPAC name is (2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine.

Molecular Properties

Compound Name(2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine
PubChem CID129348729
Molecular FormulaC10H17F2NO
Molecular Weight205.25 g/mol
Exact Mass205.13
IUPAC Name(2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine
SMILESFC(F)[C@H]1CCCN1C[C@H]1CCOC1
InChIInChI=1S/C10H17F2NO/c11-10(12)9-2-1-4-13(9)6-8-3-5-14-7-8/h8-10H,1-7H2/t8-,9-/m1/s1
InChIKeySPLMNBHQCAUQGL-RKDXNWHRSA-N
XLogP1.75
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.25
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(oxan-4-ylmethyl)-2-propan-2-ylpyrrolidine
CID 91322429
1-(oxolan-3-ylmethyl)pyrrolidine-2-carboxylic acid
CID 61313231
(2R)-2-(3-methylbutyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine
CID 129358234
2-(difluoromethyl)-1-(oxan-4-ylmethyl)piperazine
CID 174203443
1-(oxolan-3-ylmethyl)pyrrolidine
CID 66580688
2-(difluoromethyl)-4-methyl-1-(oxan-4-ylmethyl)piperazine tritetrafluoroborate
CID 174172876
(3R)-3-(difluoromethyl)-4-(oxan-4-ylmethyl)piperazine-1-carboxylic acid
CID 174172869
tert-butyl (2R)-1-(oxolan-3-ylmethyl)pyrrolidine-2-carboxylate
CID 80709054
tert-butyl (2S)-1-(oxolan-3-ylmethyl)pyrrolidine-2-carboxylate
CID 81002974
3-methyl-1-(oxolan-3-ylmethyl)piperidine
CID 77147821
1-(oxan-3-ylmethyl)-2-propan-2-ylpiperazine
CID 79001513
2-[4-(oxolan-3-ylmethyl)-1,4-diazepan-1-yl]ethanol
CID 63312870

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine?
The IUPAC name of (2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine (CID 129348729) is (2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine.
What is the SMILES notation for (2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine?
The canonical SMILES for (2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine is FC(F)[C@H]1CCCN1C[C@H]1CCOC1.
What is the InChIKey of (2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine?
The InChIKey is SPLMNBHQCAUQGL-RKDXNWHRSA-N. The full InChI is InChI=1S/C10H17F2NO/c11-10(12)9-2-1-4-13(9)6-8-3-5-14-7-8/h8-10H,1-7H2/t8-,9-/m1/s1.
What are the key properties of (2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine?
(2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine has a molecular weight of 205.25 g/mol, XLogP of 1.75, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(difluoromethyl)-1-[[(3R)-oxolan-3-yl]methyl]pyrrolidine is sourced from PubChem (CID 129348729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).